6-[[4-chloranyl-3-(2,4-dichlorophenyl)carbonyl-phenyl]sulfonylamino]hexanoic acid

Systemtic Name: 6-[[4-chloranyl-3-(2,4-dichlorophenyl)carbonyl-phenyl]sulfonylamino]hexanoic acid Openeye Name: 6-[[4-chloro-3-(2,4-dichlorobenzoyl)phenyl]sulfonylamino]hexanoic acid CAS Name: 6-[[4-chloro-3-[(2,4-dichlorophenyl)-oxomethyl]phenyl]sulfonylamino]hexanoic acid IUPAC Name: 6-[[4-chloro-3-(2,4-dichlorobenzoyl)phenyl]sulfonylamino]hexanoic acid Traditional Name: 6-[[4-chloro-3-(2,4-dichlorobenzoyl)phenyl]sulfonylamino]hexanoic acid Formula: C19H18Cl3NO5S MolecularWeight: 478.77392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCCCCCC(=O)O)C(=O)C2=C(C=C(C=C2)Cl)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCCCCCC(=O)O)C(=O)C2=C(C=C(C=C2)Cl)Cl)Cl

InChI

InChI=1S/C19H18Cl3NO5S/c20-12-5-7-14(17(22)10-12)19(26)15-11-13(6-8-16(15)21)29(27,28)23-9-3-1-2-4-18(24)25/h5-8,10-11,23H,1-4,9H2,(H,24,25)